Vitas-M small molecule compound

2-{3-(4-fluorophenyl)-5-[4-(propan-2-yl)phenyl]-4,5-dihydro-1H-pyrazol-1-yl}-4-(4-nitrophenyl)-1,3-thiazole

Catalog ID
STK754838
SMILES Fc1ccc(cc1)C1=NN(C(C1)c1ccc(cc1)C(C)C)c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C27H23FN4O2S MW 486.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23FN4O2S/c1-17(2)18-3-5-21(6-4-18)26-15-24(19-7-11-22(28)12-8-19)30-31(26)27-29-25(16-35-27)20-9-13-23(14-10-20)32(33)34/h3-14,16-17,26H,15H2,1-2H3
InChIKey
RLSFTSJROQSRGE-UHFFFAOYSA-N
Synonyms

2(3(4fluorophenyl)5(4(propan2yl)phenyl)45dihydro1Hpyrazol1yl)4(4nitrophenyl)13thiazole
2(5(4FLUOROPHENYL)3(4PROPAN2YLPHENYL)34DIHYDROPYRAZOL2YL)4(4NITROPHENYL)13THIAZOLE
CC(C)C1=CC=C(C=C1)C2CC(=NN2C3=NC(=CS3)C4=CC=C(C=C4)(N+)(=O)(O))C5=CC=C(C=C5)F
Fc1ccc(cc1)C1=NN(C(C1)c1ccc(cc1)C(C)C)c1scc(n1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC27H23FN4O2Sc117(2)183521(6418)261524(1971122(28)12819)3031(26)272925(163527)2091323(141020)32(33)34h314161726H15H212H3
MFCD00826726
ZINC000012401727
ZINC000012401728

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Available files

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